Structure Database (LMSD)

Common Name
22Z-Hentriacontenoic acid
Systematic Name
22Z-Hentriacontenoic acid
Synonyms
  • 22-Hentriacontenoic acid, (22Z)-
LM ID
LMFA01031113
Formula
Exact Mass
Calculate m/z
464.45933
Sum Composition
Status
Active

Classification

Reactions

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Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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Reactions graph legend

String Representations

InChiKey (Click to copy)
YGEBMTZEPHPZQK-KTKRTIGZSA-N
InChi (Click to copy)
InChI=1S/C31H60O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31(32)33/h9-10H,2-8,11-30H2,1H3,(H,32,33)/b10-9-
SMILES (Click to copy)
C(CCCCCCCCCCCCCCCCCCCC/C=C\CCCCCCCC)(=O)O

Other Databases

PubChem CID
PlantFA ID

Calculated Physicochemical Properties

Heavy Atoms 33
Rings 0
Aromatic Rings 0
Rotatable Bonds 28
Van der Waals Molecular Volume 557.16
Topological Polar Surface Area 37.3
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 11.18
Molar Refractivity 147.11

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Created at
-
Updated at
25th Apr 2022